EMDB/PDB/SASBDBから引用されている文献のデータベース

キーワード
構造解析手法	All X線回折 NMR 電子顕微鏡小角散乱中性子線回折線維回折粉末回折赤外分光 EPR FRET 理論モデルハイブリッド
著者・登録者
ジャーナル
IF	>30 >20 >10 >5 all

タイトル	Combining 'dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
ジャーナル・号・ページ	Acta Crystallogr. ,Sect. D, Vol. 71, Page 1777-1787, Year 2015
掲載日	2011年4月1日 (構造データの登録日)
著者	Gelin, M. / Delfosse, V. / Allemand, F. / Hoh, F. / Sallaz-Damaz, Y. / Pirocchi, M. / Bourguet, W. / Ferrer, J.L. / Labesse, G. / Guichou, J.F.
リンク	Acta Crystallogr. ,Sect. D / PubMed:26249358
手法	X線回折
解像度	1.35 - 2.554 Å
構造データ	PDB-3rdc: Human Cyclophilin D Complexed with an Inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.94 Å PDB-4xld: Crystal structure of the human PPARg-LBD/rosiglitazone complex obtained by dry co-crystallization and in situ diffraction 手法: X-RAY DIFFRACTION / 解像度: 2.45 Å PDB-4xn6: Crystal structure at room temperature of hen-egg lysozyme in complex with benzamidine 手法: X-RAY DIFFRACTION / 解像度: 1.35 Å PDB-4xnc: Crystal structure at room temperature of cyclophilin D in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2.23 Å PDB-4xne: Crystal structure of ERK2 in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-4xoy: Crystal structure of ERK2 in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2.1 Å PDB-4xoz: Crystal structure of ERK2 in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.95 Å PDB-4xp0: Crystal structure of ERK2 in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.46 Å PDB-4xp2: Crystal structure of ERK2 in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.748 Å PDB-4xp3: Crystal structure of ERK2 in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.782 Å PDB-4xrj: Crystal structure of ERK2 in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.69 Å PDB-4xrl: Crystal structure at room temperature of Erk2 in complex with an inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2.554 Å PDB-4zsc: Human Cyclophilin D Complexed with an Inhibitor at room temperature 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å PDB-4zsd: Human Cyclophilin D Complexed with an Inhibitor at room temperature 手法: X-RAY DIFFRACTION / 解像度: 1.45 Å
化合物	ChemComp-EA4: ethyl N-[(4-aminobenzyl)carbamoyl]glycinate / 1-(4-アミノベンジル)-3-(エトキシカルボニルメチル)尿素 ChemComp-HOH: WATER ChemComp-FMT: FORMIC ACID / ギ酸 ChemComp-BRL: 2,4-THIAZOLIDIINEDIONE, 5-[[4-[2-(METHYL-2-PYRIDINYLAMINO)ETHOXY]PHENYL]METHYL]-(9CL) / (5S)-5-[4-[2-[メチル(2-ピリジル)アミノ]エトキシ]ベンジル]チアゾ-ル-2,4(3H,5H)-ジオン ChemComp-BEN: BENZAMIDINE / ベンズアミジン ChemComp-TT4: 1-phenyl-1H-1,2,4-triazole-3,5-diamine / 1-フェニル-1H-1,2,4-トリアゾ-ル-3,5-ジアミン ChemComp-SO4: SULFATE ION / 硫酸ジアニオン ChemComp-DX4: 2-amino-1,9-dihydro-6H-purine-6-thione / 6-チオグアニン / 薬剤YM ChemComp-620: N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine ChemComp-DMS: DIMETHYL SULFOXIDE / 2-チアプロパン2-オキシド / DMSO, 沈殿剤YM ChemComp-42A: 1H-pyrrolo[2,3-b]pyridine-3-carbonitrile / 1H-ピロロ[2,3-b]ピリジン-3-カルボニトリル ChemComp-7I6: 1-(4-aminobenzyl)-3-[(2S)-4-(methylsulfanyl)-1-{(2R)-2-[2-(methylsulfanyl)phenyl]pyrrolidin-1-yl}-1-oxobutan-2-yl]urea / 1-(4-アミノベンジル)-3-[(S)-1-[[2β-(2-メチルチオフェニル)ピロリジン-1-イル]カルボニル]-(以下略)
由来	homo sapiens (ヒト) gallus gallus (ニワトリ) rattus norvegicus (ドブネズミ)
キーワード	ISOMERASE/ISOMERASE INHIBITOR / beta barrel / prolyl cis/trans isomerase / mitochondria / inhibitor / ISOMERASE-ISOMERASE INHIBITOR complex / GENE REGULATION / nuclear receptor ligand screening / HYDROLASE / lysozyme / ISOMERASE / inhibitor isomerase fragment based drug design / TRANSFERASE / serine threonine kinase inhibitor / SERINE/THREONINE-PROTEIN KINASE / APOPTOSIS / isomerase inhibitor complex